EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H35N5O6 |
| Net Charge | 0 |
| Average Mass | 417.507 |
| Monoisotopic Mass | 417.25873 |
| SMILES | CNC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@H](N(C)C(=O)CNC=O)[C@@H](OC)C[C@@H]2N)O1 |
| InChI | InChI=1S/C18H35N5O6/c1-21-7-10-4-5-11(19)18(28-10)29-17-12(20)6-13(27-3)15(16(17)26)23(2)14(25)8-22-9-24/h9-13,15-18,21,26H,4-8,19-20H2,1-3H3,(H,22,24)/t10-,11+,12-,13-,15+,16+,17+,18+/m0/s1 |
| InChIKey | IHPJPQIRNONWGH-GTSDWETFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Istamycin A1 (CHEBI:81438) is a formamides (CHEBI:24079) |
| Manual Xrefs | Databases |
|---|---|
| C17987 | KEGG COMPOUND |